Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Cc1csc(N2CCN(Cc3ccc(C(F)(F)F)cc3)C2=O)n1
- InChIKey
- RXQCKFYAJCTSIQ-UHFFFAOYSA-N
- 分子式
- C15H14F3N3OS
- 平均分子量
- 341.4 g/mol
- 单同位素质量
- 341.08096774
COMPUTED
结构计算性质
- XLogP
- 3.2
- 极性表面积
- 64.7 Ų
- 氢键供体
- 0
- 氢键受体
- 6
- 可旋转键
- 3
- 重原子
- 23
- 形式电荷
- 0
- 复杂度
- 440
ALIASES
名称与别名
1-(4-methylthiazol-2-yl)-3-(4-(trifluoromethyl)benzyl)imidazolidin-2-oneSCHEMBL2406041-(4-methylthiazol-2-yl)-3-(4-(trifluoromethyl)benzyl)-imidazolidin-2-one
REACTIONS
参与反应
uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08063084B2
查看uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08063084B2
查看Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D
查看uspto-grants-2012_10 · 10.6084/m9.figshare.5104873.v1 · US08293768B2
查看uspto-grants-2012_10 · 10.6084/m9.figshare.5104873.v1 · US08293768B2
查看